Geometry & MOs

Info

ID:

375989

PubChem CID:

134221988

Reduced:

ClN2O2F9C27H28 (1)

Stoich.:

AB2C2D9E27F28 (1)

Weight, g/mol:

565.185176

ΔHf, kcal/mol:

-521.7

Dipole, Da:

3.95

IP(EA), eV:

 -9.49(-1.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3,5-bis(trifluoromethyl)phenyl]-[5-ethyl-4-(8-fluoro-5-methyl-3,4-dihydro-2H-chromen-6-yl)-6-methyl-2,3-dihydroindol-1-yl]methanone

Drug info:

PubChemData

Smile

CC/C(=C(/C=C\C)\Cl)/C=C(\C)/C(/C=C/C1=CC(=C(C=C1)C(=O)N(C)NC(=O)CCC(F)(F)F)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations